UCSF

ZINC35055758

Substance Information

In ZINC since Heavy atoms Benign functionality
October 3rd, 2009 13 No

Download: MOL2 SDF SMILES Flexibase

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) -1.53 2.73 -41.54 2 5 0 74 186.211 3
Hi High (pH 8-9.5) -1.53 0.23 -45.32 1 5 -1 72 185.203 3

Activity (Go SEA)

Analogs ( Draw Identity 99% 90% 80% 70% )